ATOM 48
1 C5x C 24.4914 -18.1205
2 C1z C 25.6249 -18.9382
3 C1x C 26.6054 -18.3873
4 C1x C 26.6054 -17.0059
5 N1y N 25.4149 -16.3150
6 C1a C 25.4166 -14.9336
7 N1y N 23.0120 -17.6895
8 C1z C 24.3492 -16.8628
9 C1x C 23.9306 -15.6505
10 C1x C 22.5571 -15.5001
11 C5x C 21.9921 -16.7592
12 C8y C 24.2033 -19.7618
13 C8y C 23.0051 -19.0711
14 C8y C 21.8086 -19.7651
15 C8x C 21.8104 -21.1499
16 C8x C 23.0088 -21.8406
17 C8x C 24.2052 -21.1467
18 O5x O 20.6401 -17.0446
19 O1a O 20.6132 -19.0760
20 O5x O 23.5830 -18.6130
21 C8y C 29.4711 -21.6182
22 C8y C 29.4904 -20.2790
23 C8y C 27.2335 -20.3558
24 C8y C 27.2007 -21.6239
25 C8y C 28.3876 -22.2260
26 C8x C 28.3201 -19.6964
27 N1y N 32.9371 -18.2962
28 C1z C 32.9924 -19.6307
29 C2x C 32.9696 -22.3182
30 C2x C 34.1331 -21.6611
31 C1z C 34.1467 -20.3233
32 C1x C 35.3256 -19.6678
33 C1x C 35.3417 -18.3153
34 C1x C 34.1788 -17.6318
35 C1x C 31.7175 -17.9196
36 C1x C 31.0246 -19.0547
37 O7x O 32.9527 -20.9623
38 C1y C 31.8204 -21.6449
39 C1z C 31.8358 -20.2792
40 N1y N 30.6414 -22.3148
41 C1a C 30.6381 -23.6387
42 C1x C 35.4525 -22.0597
43 C7x C 34.2964 -22.7154
44 O6a O 34.2893 -24.0474
45 O2a O 28.4525 -23.5470
46 O2a O 26.3373 -22.2713
47 C1a C 27.2195 -24.2097
48 C1a C 24.8840 -22.2938
BOND 57
1 11 7 1
2 5 8 1
3 5 6 1
4 2 12 1
5 7 13 1
6 8 1 1 #Up
7 12 13 2
8 13 14 1
9 14 15 2
10 15 16 1
11 16 17 2
12 17 12 1
13 2 1 1 #Up
14 11 18 2
15 2 3 1
16 14 19 1
17 3 4 1
18 1 20 2
19 4 5 1
20 7 8 1
21 8 9 1
22 9 10 1
23 23 24 1
24 24 25 2
25 25 21 1
26 22 26 1
27 26 23 2
28 39 28 1
29 28 27 1
30 38 29 1
31 29 30 2
32 30 31 1
33 28 31 1
34 31 32 1
35 32 33 1
36 33 34 1
37 34 27 1
38 27 35 1
39 35 36 1
40 39 36 1 #Down
41 28 37 1 #Up
42 38 39 1
43 21 40 1
44 40 38 1
45 39 22 1
46 40 41 1
47 43 42 1
48 31 42 1 #Up
49 37 43 1
50 43 44 2
51 23 2 1
52 21 22 2
53 25 45 1
54 24 46 1
55 45 47 1
56 10 11 1
57 46 48 1
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